266321-48-6
Product Name:
METHYL TRANS-4-(4-CHLORO-[1]BENZOTHIENO[2,3-D]-PYRIMIDIN-2-YL)-CYCLOHEXANECARBOXYLATE
Formula:
C18H17ClN2O2S
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COMPUTED DESCRIPTORS
| Molecular Weight | 360.9 g/mol |
|---|---|
| XLogP3 | 5 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 5 |
| Rotatable Bond Count | 3 |
| Exact Mass | 360.0699267 g/mol |
| Monoisotopic Mass | 360.0699267 g/mol |
| Topological Polar Surface Area | 80.3 Ų |
| Heavy Atom Count | 24 |
| Formal Charge | 0 |
| Complexity | 472 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |